2-アミノ-4-(2-ナフチル)チアゾール

4-(2-Naphthyl)-1,3-thiazol-2-amine

HCID 673702CAS 21331-43-1

基本情報

標準SMILES
Nc1nc(-c2ccc3ccccc3c2)cs1
InChIKey
GWDNDNTTXIIXRS-UHFFFAOYSA-N
分子式
C13H10N2S
平均分子量
226.3 g/mol
単同位体質量
226.0564695

名称と識別子

優先名称
4-(2-Naphthyl)-1,3-thiazol-2-amine
IUPAC
4-naphthalen-2-yl-1,3-thiazol-2-amine
現地名
2-アミノ-4-(2-ナフチル)チアゾール
英語名
2-Amino-4-(2-naphthyl)thiazole
分子式
C13H10N2S
分子量
226.3

名称と別名

4-(2-naphthyl)-1,3-thiazol-2-amine2-AMINO-4-(2-NAPHTHYL)THIAZOLEEC 606-740-6RefChem:512686606-740-621331-43-14-(NAPHTHALEN-2-YL)THIAZOL-2-AMINE4-Naphthalen-2-yl-thiazol-2-ylamine4-(naphthalen-2-yl)-1,3-thiazol-2-amine4-naphthalen-2-yl-1,3-thiazol-2-amineMFCD000464524-Naphthalen-2-yl-thiazol-2-yl-amine
名称をさらに表示
2-アミノ-4-(2-ナフチル)チアゾールAKOS BBS-00000618TIMTEC-BB SBB000670IFLAB-BB F1386-03774-(2-Naphthyl)-2-thiazolamine[4-(2-naphthyl)thiazol-2-yl]amine
MLS0006883364-(2-Naphthyl)thiazol-2-amineSMR0002837574-(2-naphthyl)-1,3-thiazole-2-ylamine4-(2-naphthalenyl)-2-thiazolaminecid_673702SCHEMBL3134144CHEMBL1372017

データベース識別子

CAS
21331-43-1
PubChem CID
673702
DTXSID
DTXSID70350105
ChEMBL
CHEMBL1372017
EC Number
606-740-6
Nikkaji
J2.383.114G

物性

構造計算による物性

XLogP
3.5
極性表面積
67.2 Ų
水素結合供与体数
1
水素結合受容体数
3
回転可能結合数
1
重原子数
16

実験および物理化学的性質

Solubility11.8 [ug/mL] (The mean of the results at pH 7.4)

物理化学的性質

融点
153 · 153-155°C
沸点
443.9 · 443.9±14.0 °C(Predicted)
比重(密度)
1.301 · 1.301±0.06 g/cm3(Predicted)
蒸気圧
0 Pa · 0Pa at 25℃
貯蔵温度
2 · 2-8°C, protect from light
外見
Powder

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H301 (12.5%): Toxic if swallowed [Danger Acute toxicity, oral];H302 (12.5%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (87.5%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (25%): May cause an allergic skin reaction [Warning Sensitization, Skin];H318 (12.5%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H319 (75%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (87.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H400 (12.5%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H411 (12.5%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 8 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Regulatory InformationStatus: Active Update: 08-08-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26580
Hazard Classes and CategoriesAcute Tox. 3 (12.5%);Acute Tox. 4 (12.5%);Skin Irrit. 2 (87.5%);Skin Sens. 1 (25%);Eye Dam. 1 (12.5%);Eye Irrit. 2 (75%);STOT SE 3 (87.5%);Aquatic Acute 1 (12.5%);Aquatic Chronic 2 (12.5%)

法規制情報

Regulatory InformationStatus: Active Update: 08-08-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26580

安全データ

risk_code
36/37/38
hazard_code
Xi
safety_code
26-36/37/39
hazard_class
IRRITANT

化学と産業

サプライヤー47 社

南京波普生物医药研发有限公司025-87138562 18951783565 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Aladdin Scientific[email protected]

関連反応

3 件

関連ノート

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